Molecule ID: mol25232

SMILES: Cc1c[nH]c[n+]1C

InChI: InChI=1S/C5H8N2/c1-5-3-6-4-7(5)2/h3-4H,1-2H3/p+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.70 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization